SCHEMBL30929459

SCHEMBL30929459

COc1cc(C)cc(CNc2cnc3n(c2=O)[C@H](C(=O)OC(C)(C)C)CC3)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.41
F7 P08709 1/20 0.41
F3 P13726 1/20 0.41
PREP P48147 3/20 0.34
TP53 P04637 2/20 0.33
POLB P06746 1/20 0.33
AURKA O14965 1/20 0.33
RPS6KB1 P23443 1/20 0.33
AURKB Q96GD4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ASPH Q12797 1/20 0.33
RIOX2 Q8IUF8 1/20 0.33
KDM8 Q8N371 1/20 0.33
P2RX3 P56373 1/20 0.33
PIK3CA P42336 2/20 0.32
MTOR P42345 2/20 0.32
PRKDC P78527 2/20 0.32
PDE10A Q9Y233 2/20 0.32
CACNA1H O95180 1/20 0.31
MAPK14 Q16539 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30929456 1.00 F2 (0.41) F2F7F3PREPTP53
SCHEMBL30929415 0.93 F2 (0.44) F2F7F3PREPTP53
SCHEMBL30929437 0.89 F2 (0.42) F2F7F3PREPTP53
SCHEMBL30929417 0.89 F2 (0.41) F2F7F3PREPRPS6KB1
SCHEMBL30929453 0.87 F2 (0.40) F2F7F3PREPKDM4E
SCHEMBL30929434 0.86 BRD4 (0.46) F2F7F3PREPTP53
SCHEMBL30929429 0.82 F2 (0.44) F2F7F3PREPBRD4
SCHEMBL30929478 0.81 F2 (0.41) F2F7F3PREPTP53
SCHEMBL30929404 0.81 P2RX3 (0.33) F2F7F3P2RX3
SCHEMBL30929399 0.80 F2 (0.47) F2F7F3PREPRPS6KB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4626891-A1 FUSED PYRIMIDINES AS MASP-2 INHIBITORS Omeros Corporation (US) 2025-10-08 EP disclosed
WO-2024118840-A1 FUSED PYRIMIDINES AS MASP-2 INHIBITORS OMEROS CORPORATION (US) 2024-06-06 WO disclosed